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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Oct-2023edge,_dir_Ag140_12_oxy_continumBruix, Albertvasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-onlyGeometry optimizationDFT--414.53588935; eV
thumbnail.jpeg24-Oct-20232oxy,_dir_Ag140_2oxy_4fold_comb2Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--357.57381740; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN5_44Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.29103269; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_32Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00262888; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN5_72Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.29293205; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_89Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00523206; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_95Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.86866340; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_67Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00462431; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN5_95Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.98573320; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN7_17Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.86908071; eV
Results 31-40 of 67 (Search time: 0.001 seconds).